%chk=000139880.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000139880

0 1
 O   0.9264000     -0.8886000       1.434900    
 O    2.478700      -2.215300     -0.2421000    
 C  -0.9997000       1.159300      0.8815000    
 C   -1.527400      0.3305000     -0.2992000    
 C   0.5117000       1.411000      0.8332000    
 C   -3.015600      9.4800003E-02 -0.2846000    
 C    1.332000      0.1310000      0.8820000    
 C    2.680500      0.1214000      0.2586000    
 C   -3.522700      -1.024600      0.3591000    
 C   -3.856100       1.001100     -0.9147000    
 C    3.184100      -1.049400     -0.2707000    
 C    3.392500       1.304300      0.2329000    
 C   -4.900300      -1.242700      0.3728000    
 C   -5.233700      0.7830000     -0.9009000    
 C   -5.755700     -0.3391000     -0.2570000    
 C    4.452800      -1.037600     -0.8506000    
 C    4.661200       1.315900     -0.3468000    
 C    5.191300      0.1451000     -0.8884000    
 H   -1.513800       2.128500      0.9034000    
 H   -1.255600      0.6534000       1.821300    
 H   -1.022200     -0.6426000     -0.3384000    
 H   -1.254800      0.8290000      -1.239100    
 H   0.7379000       1.959200     -8.8200003E-02
 H   0.8011000       2.030900       1.688900    
 H   -2.864700      -1.732900      0.8545000    
 H   -3.459500       1.879000      -1.416800    
 H    3.013900       2.226400      0.6621000    
 H   -5.306900      -2.115900      0.8747000    
 H   -5.900100       1.486900      -1.390800    
 H   -6.828500     -0.5087000     -0.2460000    
 H    4.878600      -1.942400      -1.276100    
 H    5.238300       2.235700     -0.3727000    
 H    6.179600      0.1541000      -1.338700    
 H    3.005900      -2.916100     -0.6627000    


%chk=000139880-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000139880

0 1
O 0.691892 -1.118252 0.814220
O 2.831843 -2.395444 -0.277491
C -1.029888 1.092032 0.676616
C -1.703511 0.519724 -0.602350
C 0.490261 1.291415 0.516737
C -3.181801 0.230957 -0.389323
C 1.272724 -0.040631 0.499042
C 2.727735 0.008512 0.124778
C -3.584394 -0.923509 0.333837
C -4.185225 1.111590 -0.867662
C 3.479254 -1.161100 -0.222866
C 3.424189 1.251687 0.128101
C -4.950934 -1.189798 0.570746
C -5.555146 0.850131 -0.631600
C -5.942918 -0.302381 0.089441
C 4.860680 -1.063614 -0.534256
C 4.795205 1.351347 -0.173617
C 5.517074 0.180966 -0.506066
H -1.504497 2.057529 0.938062
H -1.214106 0.396371 1.515382
H -1.176420 -0.411655 -0.879866
H -1.571037 1.239642 -1.434305
H 0.715019 1.867578 -0.403201
H 0.873094 1.900239 1.362823
H -2.817291 -1.615385 0.703984
H -3.890676 2.005623 -1.432197
H 2.876777 2.161902 0.388762
H -5.243750 -2.088438 1.126196
H -6.316945 1.540750 -1.012011
H -7.003890 -0.509051 0.270974
H 5.418549 -1.971829 -0.799716
H 5.296642 2.323710 -0.149437
H 6.584664 0.236524 -0.744596
H 3.466029 -3.102541 -0.563741


